N-(2-cyanoethyl)-N-methyl-3-[(4-methylphenyl)sulfonylamino]-4-piperidin-1-yl-benzamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-3-[(4-methylphenyl)sulfonylamino]-4-piperidin-1-yl-benzamide Openeye Name: N-(2-cyanoethyl)-N-methyl-4-(1-piperidyl)-3-(p-tolylsulfonylamino)benzamide CAS Name: N-(2-cyanoethyl)-N-methyl-3-[(4-methylphenyl)sulfonylamino]-4-(1-piperidinyl)benzamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-3-[(4-methylphenyl)sulfonylamino]-4-piperidin-1-ylbenzamide Traditional Name: N-(2-cyanoethyl)-N-methyl-4-piperidino-3-(tosylamino)benzamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)N(C)CCC#N)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)N(C)CCC#N)N3CCCCC3

InChI

InChI=1S/C23H28N4O3S/c1-18-7-10-20(11-8-18)31(29,30)25-21-17-19(23(28)26(2)14-6-13-24)9-12-22(21)27-15-4-3-5-16-27/h7-12,17,25H,3-6,14-16H2,1-2H3